Hydrochloric Acid

Hydrochloric Acid

SCHEMBL3166759

C[N+]1(CCNc2nn3ccccc3c2N)CCCC1.[Cl-]

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA

The experimentally established mechanism targets of Hydrochloric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
VCP P55072 1/20 0.32
EGFR P00533 1/20 0.32
CYP2D6 P10635 1/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
KMT2A Q03164 1/20 0.31
SLC22A2 O15244 1/20 0.30
DRD2 P14416 1/20 0.30
DRD4 P21917 1/20 0.30
DRD3 P35462 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Hydrochloric Acid SCHEMBL3851767 0.99 VCP (0.31) VCPEGFRCYP2D6ALDH1A1HPGD
SCHEMBL3841138 0.99 VCP (0.32) VCPEGFRCYP2D6ALDH1A1HPGD
Hydrochloric Acid SCHEMBL1152587 0.98 CYP2D6 (0.32) VCPEGFRCYP2D6ALDH1A1HPGD
Hydrochloric Acid SCHEMBL3860287 0.98 CYP2D6 (0.32) VCPEGFRCYP2D6ALDH1A1HPGD
SCHEMBL3518957 0.98 CYP2D6 (0.33) VCPEGFRCYP2D6ALDH1A1HPGD
SCHEMBL3840367 0.91 CHRM2 (0.36) VCPEGFRCYP2D6ALDH1A1HPGD
SCHEMBL13646861 0.91 CHRM2 (0.33) VCPEGFR
SCHEMBL3841457 0.90 CHRM2 (0.35) VCPALDH1A1HPGDKMT2ASLC22A2
SCHEMBL3835633 0.89 CHRM2 (0.34) VCPALDH1A1HPGDKMT2ASLC22A2
Hydrochloric Acid SCHEMBL3852369 0.89 CNR1 (0.32) EGFRKMT2A

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7648536-B2 Method of coloring keratinous fibers comprising application of at least one aminopyrazolopyridine oxidation base in the absence of chemical oxidizing agents L'OREAL S.A. (FR) 2010-01-19 US disclosed
US-20080289121-A1 Method of coloring keratinous fibers comprising application of at least one aminopyrazolopyridine oxidation base in the absence of chemical oxidizing agents L'ORE'AL S.A. (FR) 2008-11-27 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080289121-A1 Method of coloring keratinous fibers comprising application of at least one aminopyrazolopyridine oxidation base in the absence of chemical oxidizing agents KRT18, CYBB, NOX5 VCP 1912/4885EGFR 4510/4885CYP2D6 1020/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.